5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide

C18H18N4O3S — CID 10150361

IUPAC5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)NN3C=c4cnoc4=CC3)cccc12
InChIInChI=1S/C18H18N4O3S/c1-21(2)16-7-3-6-15-14(16)5-4-8-18(15)26(23,24)20-22-10-9-17-13(12-22)11-19-25-17/h3-9,11-12,20H,10H2,1-2H3
InChIKeyKPZFSAXFIHRWLZ-UHFFFAOYSA-N
MW370.43 g/mol
LogP0.62
Rot. Bonds4

About 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide

5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide (PubChem CID 10150361) has the molecular formula C18H18N4O3S and a molecular weight of 370.43 g/mol. Its IUPAC name is 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound Name5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide
PubChem CID10150361
Molecular FormulaC18H18N4O3S
Molecular Weight370.43 g/mol
Exact Mass370.11
IUPAC Name5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)NN3C=c4cnoc4=CC3)cccc12
InChIInChI=1S/C18H18N4O3S/c1-21(2)16-7-3-6-15-14(16)5-4-8-18(15)26(23,24)20-22-10-9-17-13(12-22)11-19-25-17/h3-9,11-12,20H,10H2,1-2H3
InChIKeyKPZFSAXFIHRWLZ-UHFFFAOYSA-N
XLogP0.62
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide?
The IUPAC name of 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide (CID 10150361) is 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide?
The canonical SMILES for 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide is CN(C)c1cccc2c(S(=O)(=O)NN3C=c4cnoc4=CC3)cccc12.
What is the InChIKey of 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide?
The InChIKey is KPZFSAXFIHRWLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3S/c1-21(2)16-7-3-6-15-14(16)5-4-8-18(15)26(23,24)20-22-10-9-17-13(12-22)11-19-25-17/h3-9,11-12,20H,10H2,1-2H3.
What are the key properties of 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide?
5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide has a molecular weight of 370.43 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N-(6H-[1,2]oxazolo[4,5-c]pyridin-5-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 10150361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).